3-[(2-methoxyphenyl)methyl]-2-[(4-methylphenyl)methylsulfanyl]pteridin-4-one

Systemtic Name: 3-[(2-methoxyphenyl)methyl]-2-[(4-methylphenyl)methylsulfanyl]pteridin-4-one Openeye Name: 3-[(2-methoxyphenyl)methyl]-2-(p-tolylmethylsulfanyl)pteridin-4-one CAS Name: 3-[(2-methoxyphenyl)methyl]-2-[(4-methylphenyl)methylthio]-4-pteridinone IUPAC Name: 3-[(2-methoxyphenyl)methyl]-2-[(4-methylphenyl)methylsulfanyl]pteridin-4-one Traditional Name: 2-[(4-methylbenzyl)thio]-3-o-anisyl-pteridin-4-one Formula: C22H20N4O2S MolecularWeight: 404.4848

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC=C(C=C1)CSC2=NC3=NC=CN=C3C(=O)N2CC4=CC=CC=C4OC

Isomeric SMILES

CC1=CC=C(C=C1)CSC2=NC3=NC=CN=C3C(=O)N2CC4=CC=CC=C4OC

InChI

InChI=1S/C22H20N4O2S/c1-15-7-9-16(10-8-15)14-29-22-25-20-19(23-11-12-24-20)21(27)26(22)13-17-5-3-4-6-18(17)28-2/h3-12H,13-14H2,1-2H3